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Ligand

NameCHEMBL3718686
Molecular formulaC23H29N3O5
IUPAC nameN,N-diethyl-2-[[4-oxo-2-(oxolan-2-ylmethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-9-yl]oxy]acetamide
Molecular weight427.501
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.2
SynonymsSCHEMBL15826275
Inchi KeyDGKCTHOSOSDAJB-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H29N3O5/c1-3-25(4-2)22(27)15-30-17-7-8-19-16(12-17)9-10-26-20(19)13-21(24-23(26)28)31-14-18-6-5-11-29-18/h7-8,12-13,18H,3-6,9-11,14-15H2,1-2H3
PubChem CID90242454
ChEMBLCHEMBL3718686
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
523274G-protein coupled receptor 84Q9NQS5GPR84Homo sapiens (Human)396

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